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CAS 172314-56-6

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Hexahydro-4-methyl-5H-1,4-diazepin-5-one

Description:
Hexahydro-4-methyl-5H-1,4-diazepin-5-one, identified by its CAS number 172314-56-6, is a heterocyclic organic compound featuring a diazepine ring structure. This compound is characterized by its six-membered ring containing two nitrogen atoms at positions 1 and 4, which contributes to its unique chemical properties. The presence of a methyl group at the 4-position and a carbonyl group at the 5-position enhances its reactivity and potential applications in medicinal chemistry. Typically, compounds of this class exhibit moderate polarity due to the nitrogen atoms and functional groups, influencing their solubility in various solvents. Hexahydro-4-methyl-5H-1,4-diazepin-5-one may also display biological activity, making it of interest in pharmaceutical research. Its structural features suggest potential interactions with biological targets, which could lead to therapeutic applications. However, specific data on its toxicity, stability, and detailed reactivity would require further investigation through experimental studies.
Formula:C6H12N2O
InChI:InChI=1S/C6H12N2O/c1-8-5-4-7-3-2-6(8)9/h7H,2-5H2,1H3
InChI key:InChIKey=AFXBHHCUPRNJEL-UHFFFAOYSA-N
SMILES:O=C1N(C)CCNCC1
Synonyms:
  • 4-Methyl-1,4-diazepan-5-one
  • Hexahydro-4-methyl-5H-1,4-diazepin-5-one
  • 5H-1,4-Diazepin-5-one, hexahydro-4-methyl-
  • 5H-1,4-Diazepin-5-one,hexahydro-4-methyl-(9CI)
  • 5H-1,4-DiazepiN-5-On
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